SpectraBase Spectrum ID |
Ab1Mp5Ai1mK |
Name |
(S)-1-acetyl-2-(3-bromophenyl)-2,3-dihydroquinolin-4(1H)-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H14BrNO2 |
InChI |
InChI=1S/C17H14BrNO2/c1-11(20)19-15-8-3-2-7-14(15)17(21)10-16(19)12-5-4-6-13(18)9-12/h2-9,16H,10H2,1H3/t16-/m0/s1 |
InChIKey |
SNEWOUYOEMGSBR-INIZCTEOSA-N |
Instrument Name |
HRMS |
Ionization Type |
EI |
Molecular Weight |
344.208 g/mol |
Optical Rotation |
[a]D20 = -158.5?? (c = 0.77, CHCl3) |
SMILES |
c1ccc2c(c1)C(C[C@](N2C(=O)C)(c1cccc(c1)Br)[H])=O |
SPLASH |
splash10-0f6w-6509000000-babb5a8f514f3c1cd00b |
Sample Comments |
96% ee |
Source of Spectrum |
CN101723893A |
Wiley ID |
1841621 |